3-[[[[3-(Acetylmethylamino)-5-(dimethylcarbamoyl)-2,4,6-triiodobenzoyl]amino]acetyl]amino]-5-[(2-hydroxyethyl)carbamoyl]-2,4,6-triiodobenzoic acid

Details

Stereochemistry	ACHIRAL
Molecular Formula	C25H23I6N5O8
Molecular Weight	1282.9056
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-[[[[3-(Acetylmethylamino)-5-(dimethylcarbamoyl)-2,4,6-triiodobenzoyl]amino]acetyl]amino]-5-[(2-hydroxyethyl)carbamoyl]-2,4,6-triiodobenzoic acid

Structure Search

SMILES

CN(C)C(=O)C1=C(I)C(C(=O)NCC(=O)NC2=C(I)C(C(=O)NCCO)=C(I)C(C(O)=O)=C2I)=C(I)C(N(C)C(C)=O)=C1I

InChI

InChIKey=FHMXSJORCUZYDY-UHFFFAOYSA-N

InChI=1S/C25H23I6N5O8/c1-8(38)36(4)21-18(30)11(14(26)12(19(21)31)24(42)35(2)3)23(41)33-7-9(39)34-20-16(28)10(22(40)32-5-6-37)15(27)13(17(20)29)25(43)44/h37H,5-7H2,1-4H3,(H,32,40)(H,33,41)(H,34,39)(H,43,44)

HIDE SMILES / InChI

Molecular Formula	C25H23I6N5O8
Molecular Weight	1282.9056
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:32:08 GMT 2023` Edited by `admin` on `Sat Dec 16 18:32:08 GMT 2023`
Record UNII	N39M6PDW7W
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-[[[[3-(Acetylmethylamino)-5-(dimethylcarbamoyl)-2,4,6-triiodobenzoyl]amino]acetyl]amino]-5-[(2-hydroxyethyl)carbamoyl]-2,4,6-triiodobenzoic acid

Systematic Name

English

IOXAGLIC ACID IMPURITY D [EP IMPURITY]

Common Name

English

Code System Code Type Description

PUBCHEM

166177206

Created by admin on Sat Dec 16 18:32:08 GMT 2023 , Edited by admin on Sat Dec 16 18:32:08 GMT 2023

PRIMARY

FDA UNII

N39M6PDW7W

Created by admin on Sat Dec 16 18:32:08 GMT 2023 , Edited by admin on Sat Dec 16 18:32:08 GMT 2023

PRIMARY

Related Record Type Details


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IOXAGLIC ACID

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: